1-(Bis(4-fluorophenyl)methyl)piperazine → 6-Hydroxy-2-{4-[bis(4-fluorophenyl)methyl]piperazin-1-ylcarbonyl}-2,3-dihydro-1,4-benzodioxin

HRID 1133707Notes

Reaction equation

HRID 1133707 reaction equation
[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([N:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:6][cH:7]1.[OH:22][c:23]1[cH:24][c:25]2[c:26]([cH:34][cH:35]1)[O:27][CH:28]([C:31](=[O:32])[OH:33])[CH2:29][O:30]2>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([N:9]2[CH2:10][CH2:11][N:12]([C:31]([CH:28]3[O:27][c:26]4[c:25]([cH:24][c:23]([OH:22])[cH:35][cH:34]4)[O:30][CH2:29]3)=[O:32])[CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 1529321-(Bis(4-fluorophenyl)methyl)piperazineHCID 108780626-Hydroxy-2,3-dihydro-1,4-benzodioxin-2-carboxylic acid

Product 1

HCID 117623936-Hydroxy-2-{4-[bis(4-fluorophenyl)methyl]piperazin-1-ylcarbonyl}-2,3-dihydro-1,4-benzodioxin

Sources & evidence

ORD record
ord-6805d0bd514c485faa4efacb8fc6ce0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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